SCHEMBL12415421

SCHEMBL12415421

C=C(NC(=O)C(=C)N1C(=O)C=CC1=O)NC(=O)C(CCCCNC(=O)OC)NC(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 7/20 0.34
▸ SIRT2 Q8IXJ6 8/20 0.32
▸ TGM2 P21980 1/20 0.32
▸ EPHX1 P07099 1/20 0.32
▸ SIRT3 Q9NTG7 3/20 0.31
▸ CA1 P00915 2/20 0.31
▸ CA2 P00918 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14016183 0.78 AKT1 (0.40) SIRT1SIRT2EPHX1SIRT3CA1
SCHEMBL12037811 0.74 SIRT2 (0.40) SIRT1SIRT2TGM2SIRT3
SCHEMBL11964062 0.73 AKT1 (0.42) SIRT1SIRT2SIRT3CA1CA2
SCHEMBL10026185 0.72 AKT1 (0.39) SIRT1SIRT2EPHX1SIRT3CA1
SCHEMBL327667 0.72 SIRT1 (0.36) SIRT1SIRT2EPHX1SIRT3CA1
SCHEMBL12038022 0.72 SIRT2 (0.40) SIRT1SIRT2TGM2SIRT3
SCHEMBL14755924 0.71 AKT1 (0.41) SIRT1SIRT2SIRT3CA1CA2
SCHEMBL11964063 0.71 SIRT2 (0.38) SIRT1SIRT2SIRT3CA1CA2
SCHEMBL10167189 0.69 AKT1 (0.37) SIRT1SIRT2EPHX1
SCHEMBL14542727 0.69 AKT1 (0.36) SIRT1SIRT2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110172400-A1 COMPOSITIONS MONOVALENT FOR CD40L BINDING AND METHODS OF USE DOMANTIS LIMITED (GB) 2011-07-14 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110172400-A1 COMPOSITIONS MONOVALENT FOR CD40L BINDING AND METHODS OF USE CD40LG, CD40, CD4 SIRT1 3091/4885SIRT2 3882/4885TGM2 2782/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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